CID 71302298

2-(boc-amino)-6-aza-spiro[3.4]octane

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CC(C)(C)OC(=O)NC1CC2(C1)CCNC2
InChI
InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-9-6-12(7-9)4-5-13-8-12/h9,13H,4-8H2,1-3H3,(H,14,15)
InChIKey
RBGFMICDKNOJBB-UHFFFAOYSA-N
Compound name
tert-butyl N-(6-azaspiro[3.4]octan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

226.16812 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 155.7
[M+Na]+ 249.15734 158.3
[M-H]- 225.16084 157.9
[M+NH4]+ 244.20194 168.9
[M+K]+ 265.13128 159.6
[M+H-H2O]+ 209.16538 145.4
[M+HCOO]- 271.16632 171.4
[M+CH3COO]- 285.18197 189.6
[M+Na-2H]- 247.14279 158.6
[M]+ 226.16757 160.0
[M]- 226.16867 160.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe